2,2-dimethyl-N-[2-[1-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]benzimidazol-2-yl]ethyl]propanamide

C22H32N4O2 — CID 16975055

About 2,2-dimethyl-N-[2-[1-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]benzimidazol-2-yl]ethyl]propanamide

2,2-dimethyl-N-[2-[1-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]benzimidazol-2-yl]ethyl]propanamide (PubChem CID 16975055) has the molecular formula C22H32N4O2 and a molecular weight of 384.52 g/mol. Its IUPAC name is 2,2-dimethyl-N-[2-[1-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]benzimidazol-2-yl]ethyl]propanamide.

Molecular Properties

• Compound Name: 2,2-dimethyl-N-[2-[1-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]benzimidazol-2-yl]ethyl]propanamide
• PubChem CID: 16975055
• Molecular Formula: C22H32N4O2
• Molecular Weight: 384.52 g/mol
• Exact Mass: 384.25
• IUPAC Name: 2,2-dimethyl-N-[2-[1-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]benzimidazol-2-yl]ethyl]propanamide
• SMILES: CC1CCCCN1C(=O)Cn1c(CCNC(=O)C(C)(C)C)nc2ccccc21
• InChI: InChI=1S/C22H32N4O2/c1-16-9-7-8-14-25(16)20(27)15-26-18-11-6-5-10-17(18)24-19(26)12-13-23-21(28)22(2,3)4/h5-6,10-11,16H,7-9,12-15H2,1-4H3,(H,23,28)
• InChIKey: CRBOOHLIEMHAGB-UHFFFAOYSA-N
• XLogP: 3.14
• TPSA: 67.23 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 5
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	384.52
LogP ≤ 5	3.14
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[2-[1-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]benzimidazol-2-yl]ethyl]propanamide?

The IUPAC name of 2,2-dimethyl-N-[2-[1-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]benzimidazol-2-yl]ethyl]propanamide (CID 16975055) is 2,2-dimethyl-N-[2-[1-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]benzimidazol-2-yl]ethyl]propanamide.

What is the SMILES notation for 2,2-dimethyl-N-[2-[1-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]benzimidazol-2-yl]ethyl]propanamide?

The canonical SMILES for 2,2-dimethyl-N-[2-[1-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]benzimidazol-2-yl]ethyl]propanamide is CC1CCCCN1C(=O)Cn1c(CCNC(=O)C(C)(C)C)nc2ccccc21.

What is the InChIKey of 2,2-dimethyl-N-[2-[1-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]benzimidazol-2-yl]ethyl]propanamide?

The InChIKey is CRBOOHLIEMHAGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H32N4O2/c1-16-9-7-8-14-25(16)20(27)15-26-18-11-6-5-10-17(18)24-19(26)12-13-23-21(28)22(2,3)4/h5-6,10-11,16H,7-9,12-15H2,1-4H3,(H,23,28).

What are the key properties of 2,2-dimethyl-N-[2-[1-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]benzimidazol-2-yl]ethyl]propanamide?

2,2-dimethyl-N-[2-[1-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]benzimidazol-2-yl]ethyl]propanamide has a molecular weight of 384.52 g/mol, XLogP of 3.14, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2,2-dimethyl-N-[2-[1-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]benzimidazol-2-yl]ethyl]propanamide is sourced from PubChem (CID 16975055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).